>compound Kaempferol-3-O-glucoside_Kaempferol-3-O-glucoside
#instrument UPLC Q-Tof Premier, Waters
>formula C21H20O11
#smiles OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1OC(C(=O)2)=C(c(c4)ccc(O)c4)Oc(c3)c(c(O)cc(O)3)2
#RECORD LC-ESI-QTOF_train_data/PR100971.txt;LC-ESI-QTOF_train_data/PR100662.txt;LC-ESI-QTOF_train_data/PR100243.txt;LC-ESI-QTOF_train_data/PR100663.txt;LC-ESI-QTOF_train_data/PR101025.txt
>charge -1
>ionization [M-H]-
>parentmass 447.09274

>collision 5-60
183.0461 435.5
227.0359 4238.0
228.0409 307.5
255.0314 4561.0
256.0389 676.1
284.034 3694.0
285.0432 1730.0
447.0927 5017.0
448.1042 492.5

>collision 5-60
183.048 533.8
211.0434 284.2
227.0374 4750.0
255.033 5080.0
256.0425 484.0
284.0357 4208.0
285.0455 1918.0
447.0928 5153.0
447.6235 277.7

>collision 5-60
68.9993 31.28
69.0352 75.53
81.0349 52.02
85.0299 325.0
91.0404 25.6
93.0336 21.46
97.0299 109.7
105.0351 21.73
107.0514 23.82
109.0302 56.19
111.0088 38.64
121.0301 155.7
127.0413 72.97
133.0301 28.13
137.0252 48.02
145.0531 79.75
147.0461 35.33
153.0202 258.4
157.0675 41.33
165.0204 138.5
171.047 21.85
185.0624 28.53
213.0575 87.35
231.0686 39.29
241.0523 45.87
258.055 60.99
259.0617 24.59
286.985 30.31
287.0565 4236.0
288.062 83.96
449.1084 61.99

>collision 30
151.0036 208.9
163.004 100.4
211.0401 126.2
227.0345 6315.0
228.0424 152.7
229.0512 420.6
239.0348 113.8
255.029 9844.0
255.2883 126.0
255.429 256.5
256.0391 1401.0
257.0477 331.1
284.0327 7335.0
285.0419 2158.0
447.0928 100.5

>collision 5-60
69.0354 163.0
85.0293 692.6
97.0291 241.6
121.0285 297.7
127.0394 180.7
145.0505 171.7
153.0183 508.6
165.0183 277.2
213.0548 170.1
258.0531 131.6
287.0532 8566.0
288.0579 318.7
449.1084 153.5

